Geometry & MOs

Info

ID:	449227
PubChem CID:	135296986
Reduced:	N4O4C25H28 (1)
Stoich.:	A4B4C25D28 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-95.77
Dipole, Da:	10.4
IP(EA), eV:	-9.32(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-10-methoxy-3,3,9-trimethyl-15-oxo-1,2-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-7(12),8,10,13,16-pentaene-16-carboxylic acid

Drug info:

PubChemData

Smile

CC1(CC[C@H]2N1N3C=C(C(=O)C=C3C4=C2C=C(C(=C4)OC)CCC5=CN=CN5C)C(=O)O)C

DOS

IR

Vibrations